4-[[(5S)-9-pyridin-4-ylcarbonyl-3,9-diazaspiro[4.5]decan-3-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(5S)-9-pyridin-4-ylcarbonyl-3,9-diazaspiro[4.5]decan-3-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[(5S)-9-(pyridine-4-carbonyl)-3,9-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile CAS Name: 4-[[(5S)-9-[oxo(pyridin-4-yl)methyl]-3,9-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile IUPAC Name: 4-[[(5S)-9-(pyridine-4-carbonyl)-3,9-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile Traditional Name: 4-[[(5S)-9-isonicotinoyl-3,9-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCN(C2)CC3=CC=C(C=C3)C#N)CN(C1)C(=O)C4=CC=NC=C4

Isomeric SMILES

C1C[C@@]2(CCN(C2)CC3=CC=C(C=C3)C#N)CN(C1)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C22H24N4O/c23-14-18-2-4-19(5-3-18)15-25-13-9-22(16-25)8-1-12-26(17-22)21(27)20-6-10-24-11-7-20/h2-7,10-11H,1,8-9,12-13,15-17H2/t22-/m0/s1